SCHEMBL4566618

SCHEMBL4566618

[CH2]CCCOCC(=C)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.32
TET2 Q6N021 3/20 0.31
TET3 O43151 1/20 0.31
TET1 Q8NFU7 1/20 0.31
GRIK1 P39086 1/20 0.30
GRIK2 Q13002 1/20 0.30
GRM1 Q13255 1/20 0.30
GRM2 Q14416 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2786442 0.81 CES2 (0.48) CES2
SCHEMBL8694378 0.79
SCHEMBL351637 0.78 TET2 (0.40) TET2TET3TET1GRIK1GRIK2
SCHEMBL16506255 0.78 CES2 (0.60) CES2
SCHEMBL9499750 0.78 CES2 (0.60) CES2
SCHEMBL277984 0.77 TSHR (0.41) TET2TET3TET1GRIK1GRIK2
SCHEMBL19611128 0.77
SCHEMBL2219165 0.76 CES2 (0.38) CES2TET2TET3TET1GRIK1
SCHEMBL3208895 0.74 MEN1 (0.48) TET2TET3TET1GRIK1GRIK2
SCHEMBL3286421 0.74 ALDH1A1 (0.35) TET2TET3TET1GRIK1GRIK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090285989-A1 Dispersion, Ink, Process, Use and Dispersant FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-11-19 US disclosed